SCHEMBL10648232

SCHEMBL10648232

N#Cc1ccc(NC(=O)C(F)(F)C(F)(F)C(F)(F)F)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 7/20 0.76
HDAC7 Q8WUI4 7/20 0.76
HDAC8 Q9BY41 7/20 0.76
HDAC6 Q9UBN7 6/20 0.76
MLYCD O95822 1/20 0.52
CA1 P00915 3/20 0.51
CA2 P00918 3/20 0.51
MAPT P10636 3/20 0.49
LMNA P02545 2/20 0.49
TSHR P16473 1/20 0.49
HTT P42858 1/20 0.49
NLRP3 Q96P20 1/20 0.49
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
SAE1 Q9UBE0 1/20 0.47
UBA2 Q9UBT2 1/20 0.47
KDM4E B2RXH2 1/20 0.47
POLB P06746 1/20 0.47
PKM P14618 1/20 0.47
MAPK1 P28482 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5785443 0.83 HDAC1 (0.69) HDAC1HDAC7HDAC8HDAC6MLYCD
SCHEMBL20941785 0.83 HDAC1 (0.65) HDAC1HDAC7HDAC8HDAC6MLYCD
SCHEMBL10649341 0.80 KMT2A (0.52) HDAC1HDAC7HDAC8HDAC6CA1
SCHEMBL20941784 0.80 HDAC1 (0.66) HDAC1HDAC7HDAC8HDAC6MLYCD
SCHEMBL17577313 0.80 CA1 (0.56) HDAC1HDAC7HDAC8HDAC6CA1
SCHEMBL26624042 0.80 CA1 (0.56) HDAC1HDAC7HDAC8HDAC6CA1
SCHEMBL7523309 0.79 PDK1 (0.70) HDAC1HDAC7HDAC8HDAC6TSHR
SCHEMBL10648856 0.78 HDAC1 (0.49) HDAC1HDAC7HDAC8HDAC6CA1
SCHEMBL8846991 0.78 HDAC1 (0.72) HDAC1HDAC7HDAC8HDAC6CA1
SCHEMBL20941547 0.76 HDAC1 (0.61) HDAC1HDAC7HDAC8HDAC6MLYCD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4764623-A N-(1H-tetrazol-5-yl-alkylphenyl)polyfluoroalkanamides AMERICAN HOME PRODUCTS CORPORATION (US) 1988-08-16 US disclosed